1-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one

Systemtic Name: 1-[4-(5-chloranyl-1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Openeye Name: 1-[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidyl]-3-(1-phenylpyrazol-4-yl)propan-1-one CAS Name: 1-[4-(5-chloro-1,3-benzothiazol-2-yl)-1-piperidinyl]-3-(1-phenyl-4-pyrazolyl)-1-propanone IUPAC Name: 1-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidin-1-yl]-3-(1-phenylpyrazol-4-yl)propan-1-one Traditional Name: 1-[4-(5-chloro-1,3-benzothiazol-2-yl)piperidino]-3-(1-phenylpyrazol-4-yl)propan-1-one Formula: C24H23ClN4OS MolecularWeight: 450.98362

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=C(S2)C=CC(=C3)Cl)C(=O)CCC4=CN(N=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1C2=NC3=C(S2)C=CC(=C3)Cl)C(=O)CCC4=CN(N=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H23ClN4OS/c25-19-7-8-22-21(14-19)27-24(31-22)18-10-12-28(13-11-18)23(30)9-6-17-15-26-29(16-17)20-4-2-1-3-5-20/h1-5,7-8,14-16,18H,6,9-13H2